7-Chloro-N-[3-(octylamino)propyl]-4-quinolinamine1-oxide

Modify Date: 2025-09-11 19:26:49

7-Chloro-N-[3-(octylamino)propyl]-4-quinolinamine1-oxide Structure
7-Chloro-N-[3-(octylamino)propyl]-4-quinolinamine1-oxide structure
Common Name 7-Chloro-N-[3-(octylamino)propyl]-4-quinolinamine1-oxide
CAS Number 63680-59-1 Molecular Weight 363.92500
Density 1.12g/cm3 Boiling Point 473.9ºC at 760 mmHg
Molecular Formula C20H30ClN3O Melting Point N/A
MSDS N/A Flash Point 240.4ºC

 Names

Name (4E)-7-Chloro-4-{[3-(octylamino)propyl]imino}-1(4H)-quinolinol

 Chemical & Physical Properties

Density 1.12g/cm3
Boiling Point 473.9ºC at 760 mmHg
Molecular Formula C20H30ClN3O
Molecular Weight 363.92500
Flash Point 240.4ºC
Exact Mass 363.20800
PSA 49.55000
LogP 5.16380
Index of Refraction 1.562
InChIKey VIOIYFCDKJWGFX-UHFFFAOYSA-N
SMILES CCCCCCCCNCCCN=c1ccn(O)c2cc(Cl)ccc12

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VB4025000
CHEMICAL NAME :
Quinoline, 7-chloro-4-(3-octylaminopropyl)amino-, 1-oxide
CAS REGISTRY NUMBER :
63680-59-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H30-Cl-N3-O
MOLECULAR WEIGHT :
363.98
WISWESSER LINE NOTATION :
T66 BNJ BO EM3M8 IG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
40 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490
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